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4-Chloro-2-fluorobenzeneacetonitrile

4-Chloro-2-fluorobenzeneacetonitrile structure

CAS No:
75279-53-7
Formula:
C8H5ClFN
Chemical Name:
4-Chloro-2-fluorobenzeneacetonitrile
Synonyms:
Benzeneacetonitrile,4-chloro-2-fluoro-;4-Chloro-2-fluorobenzeneacetonitrile;(4-Chloro-2-fluorophenyl)acetonitrile;2-(4-Chloro-2-fluorophenyl)acetonitrile;2-(2-Fluoro-4-chlorophenyl)acetonitrile
Categories:
Organic Chemistry > Organic Fluorine Compound

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4-Chloro-2-fluorobenzeneacetonitrile Basic Attributes

Molecular Weight：

169.58

Exact Mass：

169.58

EC Number：

642-783-7

DSSTox ID：

DTXSID40371448

HScode：

2926909090

Characteristics

PSA：

23.8

XLogP3：

2.3

Density：

1.3±0.1 g/cm3

Melting Point：

37-41℃

Boiling Point：

133 °C

Flash Point：

103.7±23.2 °C

Refractive Index：

1.528

Safety Information

Packing level：

Ⅲ

Hazard category：

6.1

Transport codes：

3276

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Marks：

T,C,Xn

Hazard note：

Toxic

Precautionary statement(s)：

P261, P264, P270, P271, P273, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (28.57%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:169.58
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:169.0094550
Monoisotopic Mass:169.0094550
Topological Polar Surface Area:23.8
Heavy Atom Count:11
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-Chloro-2-fluorophenylacetonitrile

CAS No.: 75279-53-7

Content: 99.00%

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Guide of 4-Chloro-2-fluorobenzeneacetonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties
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4-Chloro-2-fluorobenzeneacetonitrile

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